Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 5/20 | 0.77 |
| ▸ | RAB9A | P51151 | 4/20 | 0.77 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.69 |
| ▸ | HPGD | P15428 | 1/20 | 0.69 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.68 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.68 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.68 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.62 |
| ▸ | NAAA | Q02083 | 1/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.62 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.62 |
| ▸ | NFKB2 | Q00653 | 1/20 | 0.62 |
| ▸ | RELA | Q04206 | 1/20 | 0.62 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.61 |
| ▸ | GAA | P10253 | 1/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | MEN1 | O00255 | 1/20 | 0.60 |
| ▸ | PDE5A | O76074 | 1/20 | 0.58 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.57 |
| ▸ | NAMPT | P43490 | 1/20 | 0.57 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL6359384 | 0.97 | NPC1 (0.81) | NPC1RAB9ASMN1; SMN2HPGDHDAC3 | |
| SCHEMBL13577912 | 0.92 | NPC1 (0.84) | NPC1RAB9ASMN1; SMN2HPGDHDAC3 | |
| SCHEMBL4728815 | 0.91 | NPC1 (0.88) | NPC1RAB9ASMN1; SMN2HPGDHDAC3 | |
| SCHEMBL9967364 | 0.91 | NPC1 (0.88) | NPC1RAB9ASMN1; SMN2HPGDHDAC3 | |
| SCHEMBL5694328 | 0.91 | NPC1 (0.88) | NPC1RAB9ASMN1; SMN2HPGDHDAC3 | |
| SCHEMBL24420725 | 0.91 | NPC1 (0.88) | NPC1RAB9ASMN1; SMN2HPGDHDAC3 | |
| SCHEMBL13356507 | 0.88 | NPC1 (0.77) | NPC1RAB9ASMN1; SMN2HPGDHDAC3 | |
| SCHEMBL11754310 | 0.87 | NPC1 (1.00) | NPC1RAB9ASMN1; SMN2HPGDHDAC3 | |
| SCHEMBL11758269 | 0.87 | NPC1 (1.00) | NPC1RAB9ASMN1; SMN2HPGDHDAC3 | |
| SCHEMBL9489987 | 0.87 | NPC1 (1.00) | NPC1RAB9ASMN1; SMN2HPGDHDAC3 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-104761420-B | Method for synthesizing amide from methyl aromatic hydrocarbon and amine in water phase | 江西师范大学 | 2021-03-05 | — | — | CN | disclosed |